2-[(Bromoacetyl)Amino]-2-Deoxy-D-Glucose

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Properties Simple | Detailed

Formula C8H14BrNO6
IUPAC Name 2-bromo-n-[(1r,2r,3s,4r)-1-formyl-2,3,4,5-tetrahydroxy-pentyl]acetamide
Molecular Mass 300.104 g·mol−1
Heat of Formation -1099.4 ± 16.7 kJ·mol−1
Dipole Moment 2.62 ± 1.08 D
Volume 286.25 Å 3
Surface Area 255.89 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
Synonyms
  • 2-((bromoacetyl)amino)-2-deoxy-beta-d-glucopyranose
  • 2-bromo-n-[(1r,2r,3s,4r)-1-formyl-2,3,4,5-tetrahydroxy-pentyl]acetamide
  • 2-bromo-n-[(1r,2r,3s,4r)-1-formyl-2,3,4,5-tetrahydroxypentyl]acetamide
  • 2-bromo-n-[(2r,3r,4s,5r)-3,4,5,6-tetrahydroxy-1-oxo-hexan-2-yl]ethanamide
  • 2-bromo-n-[(2r,3r,4s,5r)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide
  • 2-deoxy-2-(bromoacetamido)-d-glucose
  • d-glucose, 2-((bromoacetyl)amino)-2-deoxy-
  • d-glucose, 2-(2-bromoacetamido)-2-deoxy-
  • n-bromoacetylglucosamine
  • n-bromoacetylglucoseamine
CAS Number(s)
  • 26944-26-3
InChIKey OFCLIDPLXVQJAP-LRSZDJBLSA-N
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Elements H C O Br N